Bmy 28160
TL;DR: Bmy 28160 (CAS 94593-78-9) is a chemical compound with molecular formula C53H90N12O12 and molecular weight 1086.68 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
12,21,27-tris(2-aminoethyl)-18-benzyl-31-butan-2-yl-3-(hydroxymethyl)-6,15-bis(2-methylpropyl)-9,24-di(propan-2-yl)-1-oxa-4,7,10,13,16,19,22,25,28-nonazacyclohentriacontane-2,5,8,11,14,17,20,23,26,29-decone
Also Known As: Bmy 28160, Polypeptin A, 2-L-valine-9-L-serine-, 12,21,27-tris(2-aminoethyl)-18-benzyl-31-butan-2-yl-3-(hydroxymethyl)-6,15-bis(2-methylpropyl)-9,24-di(propan-2-yl)-1-oxa-4,7,10,13,16,19,22,25,28-nonazacyclohentriacontane-2,5,8,11,14,17,20,23,26,29-decone
| Molecular Formula | C53H90N12O12 |
|---|---|
| Molecular Weight | 1086.68 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 386.0 Ų |
| Hydrogen Bond Donors | 13 |
| Hydrogen Bond Acceptors | 15 |
| Rotatable Bonds | 17 |
| Exact Mass | 1086.6802 |
| Heavy Atoms | 77 |
| Complexity | 1950.0 |
Chemical Identifiers
| CAS Number | 94593-78-9 |
|---|---|
| SMILES | CCC(C)C1CC(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)O1)CO)CC(C)C)C(C)C)CCN)CC(C)C)CC2=CC=CC=C2)CCN)C(C)C)CCN |
| InChIKey | DTKPLFMHHIBZIK-UHFFFAOYSA-N |
Product Overview
Bmy 28160 (CAS 94593-78-9), with molecular formula C53H90N12O12 and molecular weight 1086.68 g/mol. IUPAC: 12,21,27-tris(2-aminoethyl)-18-benzyl-31-butan-2-yl-3-(hydroxymethyl)-6,15-bis(2-methylpropyl)-9,24-di(propan-2-yl)-1-oxa-4,7,10,13,16,19,22,25,28-nonazacyclohentriacontane-2,5,8,11,14,17,20,23,26,29-decone.
Chemical Property Profile of Bmy 28160
Property Insights of Bmy 28160
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Bmy 28160. The TPSA of 386.0 Ų indicates high polarity, suggesting Bmy 28160 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Bmy 28160 has 13 hydrogen bond donor(s) and 15 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Bmy 28160?
The CAS number of Bmy 28160 is 94593-78-9.
What is the molecular formula of Bmy 28160?
The molecular formula of Bmy 28160 is C53H90N12O12.
What is the molecular weight of Bmy 28160?
The molecular weight of Bmy 28160 is 1086.68 g/mol.
Where can I buy Bmy 28160?
You can request a quote for Bmy 28160 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bmy 28160?
Yes, KEHONG BIO provides custom synthesis services for Bmy 28160 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.